BAS 03539885
TL;DR: BAS 03539885 (CAS 500195-48-2) is a chemical compound with molecular formula C24H28N2O5S and molecular weight 456.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[hydroxy-(4-methoxy-2-methylphenyl)methylidene]-1-(3-morpholin-4-ylpropyl)-5-thiophen-2-ylpyrrolidine-2,3-dione
Also Known As: BAS 03539885, 3-hydroxy-4-(4-methoxy-2-methylbenzoyl)-1-[3-(morpholin-4-yl)propyl]-5-(thiophen-2-yl)-2,5-dihydro-1H-pyrrol-2-one, 4-[hydroxy-(4-methoxy-2-methylphenyl)methylidene]-1-(3-morpholin-4-ylpropyl)-5-thiophen-2-ylpyrrolidine-2,3-dione
| Molecular Formula | C24H28N2O5S |
|---|---|
| Molecular Weight | 456.17 g/mol |
| LogP | 3.20912 |
| Topological Polar Surface Area | 79.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 456.1719 |
| Heavy Atoms | 32 |
| Complexity | 1011.40186 |
Chemical Identifiers
| CAS Number | 500195-48-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OC)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=CS4)O |
Product Overview
BAS 03539885 (CAS 500195-48-2), with molecular formula C24H28N2O5S and molecular weight 456.17 g/mol. IUPAC: 4-[hydroxy-(4-methoxy-2-methylphenyl)methylidene]-1-(3-morpholin-4-ylpropyl)-5-thiophen-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03539885
Property Insights of BAS 03539885
The XLogP value of 3.20912 indicates that BAS 03539885 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.31 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03539885. Following Lipinski's Rule of Five, BAS 03539885 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 03539885?
The CAS number of BAS 03539885 is 500195-48-2.
What is the molecular formula of BAS 03539885?
The molecular formula of BAS 03539885 is C24H28N2O5S.
What is the molecular weight of BAS 03539885?
The molecular weight of BAS 03539885 is 456.17 g/mol.
Where can I buy BAS 03539885?
You can request a quote for BAS 03539885 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03539885?
Yes, KEHONG BIO provides custom synthesis services for BAS 03539885 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.